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Structure

4'-Methylbiphenyl-4-carboxylic acid

CAS
720-73-0
Catalog Number
ACM720730
Category
Main Products
Molecular Weight
212.2
Molecular Formula
C14H12O2

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Specification

Synonyms
4-hydroxycarbonyl-4-methylbiphenyl; 4-methyl-4-biphenylcarboxylic acid; 4-Methylbiphenyl-4-carboxylic acid;
IUPAC Name
4-(4-methylphenyl)benzoicacid
Canonical SMILES
CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
InChI Key
RZOCCLOTCXINRG-UHFFFAOYSA-N
Melting Point
252-253ºC
Exact Mass
212.08400
Hazard Statements
Xi
What is the molecular formula of 4'-Methylbiphenyl-4-carboxylic acid?

The molecular formula is C14H14O2.

What are the synonyms for 4'-Methylbiphenyl-4-carboxylic acid?

The synonyms are 4-Methylbiphenyl-4-carboxylic acid and 1-methyl-4-phenylcyclohexa-2,4-diene-1-carboxylic acid.

What is the molecular weight of 4'-Methylbiphenyl-4-carboxylic acid?

The molecular weight is 214.26 g/mol.

When was 4'-Methylbiphenyl-4-carboxylic acid created?

It was created on November 30, 2012.

When was 4'-Methylbiphenyl-4-carboxylic acid last modified?

It was last modified on October 21, 2023.

What is the IUPAC name of 4'-Methylbiphenyl-4-carboxylic acid?

The IUPAC name is 1-methyl-4-phenylcyclohexa-2,4-diene-1-carboxylic acid.

What is the InChI of 4'-Methylbiphenyl-4-carboxylic acid?

The InChI is InChI=1S/C14H14O2/c1-14(13(15)16)9-7-12(8-10-14)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,16).

What is the InChIKey of 4'-Methylbiphenyl-4-carboxylic acid?

The InChIKey is BKRFJQKHEOASIZ-UHFFFAOYSA-N.

What is the canonical SMILES of 4'-Methylbiphenyl-4-carboxylic acid?

The canonical SMILES is CC1(CC=C(C=C1)C2=CC=CC=C2)C(=O)O.

What is the XLogP3-AA value of 4'-Methylbiphenyl-4-carboxylic acid?

The XLogP3-AA value is 2.9.

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